AMBER Archive (2001)

Subject: GB and Ions

From: Andreas Svrcek-Seiler (svrci_at_tbi.univie.ac.at)
Date: Mon Apr 09 2001 - 05:21:06 CDT

Dear experts,
Is it useless/wrong to add some counterions in a GB/SA simulation
or would it be worth a try ?
... And if it's worth a try, can someone prove an educated guess
what born radius to assign to e.g. a sodium ion ?

best regards
W. A. Svrcek-Seiler 

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